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Bile acid

LIPID_IDBA0472

CHEM_NA3¦Á,6¦Â,7¦Á,12¦Á-TETRAHYDROXY-5¦Â-CHOLAN-2

4-OIC ACID

COMMON_NA

MOL_FORMULAC24H40O6

MOL_WT424

MELT_PT154¡Á157¡¬C(031)

BOIL_PT

OPT_ROT

REFRA_IND

DENSITY

SOLUBILITY

UV_SPEC

IR_SPEC1703(C=O),3538,1014,986,952(OH)(031)

NMR_SPECMETHYL ESTER DERIVATIVE 1H-NMR(CDCl3) 18-Me

0.72(s),19-Me 1.06(s),21-Me 0.98(d),COOMe 3.67(s)

13C-NMR C1 35.7,C2 29.9,C3 71.4,C4 35.9,C5

47.4,C6 76.0,C7 73.2,C8 35.3,C9 26.6,C10 34.5,C11

27.7,C12 73.2,C13 46.4,C14 41.1,C15 23.3,C16

27.5,C17 47.0,C18

MS_SPECMETHYL ESTER DERIVATIVE m/z

402,384,366,305,287,269,260,251 (031)

NOTE_SPEC

SOURCE¥Ò¥ÈÇ¢(021/032/033)¡¤¥Ò¥ÈÍÓ¿å(033)

BIOL_ACTIV

NOTE

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